[4-(3,3-dimethylbutanoylamino)phenyl]methylazanium

Systemtic Name: [4-(3,3-dimethylbutanoylamino)phenyl]methylazanium Openeye Name: [4-(3,3-dimethylbutanoylamino)phenyl]methylammonium CAS Name: [4-[(3,3-dimethyl-1-oxobutyl)amino]phenyl]methylammonium IUPAC Name: [4-(3,3-dimethylbutanoylamino)phenyl]methylazanium Traditional Name: [4-(3,3-dimethylbutanoylamino)benzyl]ammonium Formula: C13H21N2O+ MolecularWeight: 221.31864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=CC=C(C=C1)C[NH3+]

Isomeric SMILES

CC(C)(C)CC(=O)NC1=CC=C(C=C1)C[NH3+]

InChI

InChI=1S/C13H20N2O/c1-13(2,3)8-12(16)15-11-6-4-10(9-14)5-7-11/h4-7H,8-9,14H2,1-3H3,(H,15,16)/p+1